4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide

C11H16N2O4S — CID 5307401

IUPAC4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide
SMILESCC1CCCCN1S(=O)(=O)c1coc(C(N)=O)c1
InChIInChI=1S/C11H16N2O4S/c1-8-4-2-3-5-13(8)18(15,16)9-6-10(11(12)14)17-7-9/h6-8H,2-5H2,1H3,(H2,12,14)
InChIKeyMWPCKQVDSDVMIN-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.94
Rot. Bonds3

About 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide

4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide (PubChem CID 5307401) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide.

Molecular Properties

Compound Name4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide
PubChem CID5307401
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide
SMILESCC1CCCCN1S(=O)(=O)c1coc(C(N)=O)c1
InChIInChI=1S/C11H16N2O4S/c1-8-4-2-3-5-13(8)18(15,16)9-6-10(11(12)14)17-7-9/h6-8H,2-5H2,1H3,(H2,12,14)
InChIKeyMWPCKQVDSDVMIN-UHFFFAOYSA-N
XLogP0.94
TPSA93.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide
CID 5307412
1-(3,5-dichlorophenyl)sulfonyl-2-methylpiperidine
CID 21364435
3-methyl-5-(2-methylpiperidin-1-yl)sulfonylaniline
CID 43255635
5-methyl-4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxylic acid
CID 62805389
(2S)-2-methyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine
CID 1168281
6-(2-methylpiperidin-1-yl)sulfonyl-2-oxo-1H-quinoline-4-carboxamide
CID 118553851
(4-aminopiperidin-1-yl)-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]methanone;hydrochloride
CID 119376603
2-[[4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzoyl]amino]thiophene-3-carboxamide
CID 7164097
(2S)-1-(4-chlorophenyl)sulfonyl-2-methylpiperidine
CID 668791
N-(2-aminoethyl)-2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 119384497
1-(3,4-difluorophenyl)sulfonyl-2-methylpiperidine
CID 3701058
N-cyclopropyl-3-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
CID 9165564

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide?
The IUPAC name of 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide (CID 5307401) is 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide.
What is the SMILES notation for 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide?
The canonical SMILES for 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide is CC1CCCCN1S(=O)(=O)c1coc(C(N)=O)c1.
What is the InChIKey of 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide?
The InChIKey is MWPCKQVDSDVMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-8-4-2-3-5-13(8)18(15,16)9-6-10(11(12)14)17-7-9/h6-8H,2-5H2,1H3,(H2,12,14).
What are the key properties of 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide?
4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide has a molecular weight of 272.33 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperidin-1-yl)sulfonylfuran-2-carboxamide is sourced from PubChem (CID 5307401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).